BioLiP

PDB

BioLiP

PDB CCD ID:

A1BM1

Number of entries in BioLiP:

Chemical formula:

C10 H10 N2

InChI:

InChI=1S/C10H10N2/c1-11-10-7-6-8-4-2-3-5-9(8)12-10/h2-7H,1H3,(H,11,12)

InChIKey:

POVSMFKXVSNGSU-UHFFFAOYSA-N

SMILES:

Software	SMILES
ACDLabs 14.52 CACTVS 3.385 OpenEye OEToolkits 3.1.0.0	CNc1ccc2ccccc2n1

Name:

N-methylquinolin-2-amine

ChEMBL:

CHEMBL319543

Reference:

Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).

Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).